methyl 2-diazanyl-5-hexadecyl-4-oxidanylidene-1H-pyrimidine-6-carboxylate

Systemtic Name: methyl 2-diazanyl-5-hexadecyl-4-oxidanylidene-1H-pyrimidine-6-carboxylate Openeye Name: methyl 5-hexadecyl-2-hydrazino-4-oxo-1H-pyrimidine-6-carboxylate CAS Name: 5-hexadecyl-2-hydrazinyl-4-oxo-1H-pyrimidine-6-carboxylic acid methyl ester IUPAC Name: methyl 5-hexadecyl-2-hydrazinyl-4-oxo-1H-pyrimidine-6-carboxylate Traditional Name: 5-cetyl-2-hydrazino-4-keto-1H-pyrimidine-6-carboxylic acid methyl ester Formula: C22H40N4O3 MolecularWeight: 408.578

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCC1=C(NC(=NC1=O)NN)C(=O)OC

Isomeric SMILES

CCCCCCCCCCCCCCCCC1=C(NC(=NC1=O)NN)C(=O)OC

InChI

InChI=1S/C22H40N4O3/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19(21(28)29-2)24-22(26-23)25-20(18)27/h3-17,23H2,1-2H3,(H2,24,25,26,27)